PerlMol version 0.2300
======================
PerlMol is a collection of Perl modules for chemoinformatics and computational
chemistry with the philosophy that "simple things should be simple". It should
be possible to write one-liners that use this toolkit to do meaningful
"molecular munging". The perlmol toolkit provides objects and methods for
representing molecules, atoms, and bonds in Perl; doing substructure matching;
and reading and writing files in various formats.
This is a bundle containing all of the modules of the PerlMol Project and their
dependencies.
CONTENTS
Math::VectorReal 1.02
Statistics-Regression 0.15
Chemistry::Mol 0.24
Chemistry::MacroMol 0.05
Chemistry::InternalCoords 0.11
Chemistry::Ring 0.11
Chemistry::Canonicalize 0.10
Chemistry::Bond::Find 0.21
Chemistry::File::MDLMol 0.15
Chemistry::File::SMILES 0.40
Chemistry::Pattern 0.21
Chemistry::File::PDB 0.15
Chemistry::File::Mopac 0.10
Chemistry::File::SMARTS 0.10
Chemistry::Mok 0.21
INSTALLATION
To install this module type the following:
perl Makefile.PL
make
make test
make install
DEPENDENCIES
perl-5.6.0 or a more recent version.
If you have perl-5.8.0 (or a more recent version), this bundle has everything
you need. If you have an earlier version of Perl, you also need these core
modules:
Test::Simple 0.45
Scalar::Util 1.07
Storable 2.04
Text::Balanced 1.89
COPYRIGHT AND LICENSE
Copyright (C) 2004 Ivan Tubert
This library is free software; you can redistribute it and/or modify
it under the same terms as Perl itself.